Exact analytical expressions and numerical analysis of two-center Franck-Condon factors and matrix elements over displaced harmonic oscillator wave functions

DOI10.1016/J.CPC.2006.04.002MaRDI QIDQ710009zbMATH OpenOpenAlexFDO

Authors I. I. Guseinov, A. S. Ekenoğlu, Bahtiyar A. Mamedov

Publication date 18 October 2010

Published in Computer Physics Communications (Search for Journal in Brave)

Full work available at URL https://doi.org/10.1016/j.cpc.2006.04.002

zbMATH Keywords

binomial coefficientsFranck-Condon factorsharmonic oscillator wave functionsHermite polynomialsoverlap integrals

Mathematics Subject Classification ID

Basic linear algebra (15A99) Numerical linear algebra (65F99)

Recommendations

• Derivation of closed analytical expressions for Rosen-Morse Franck-Condon factors
• Algebraic derivation of Franck-Condon overlap integrals for diatomic molecules
• Calculation of Displacement Matrix Elements for Morse Oscillators
• Franck-Condon factors for diatomic molecules for an arbitrary anharmonic potential
• Recurrence relations for two-center harmonic oscillator integrals

Cites work

• Calculation of the generalized Hubbell rectangular source integrals using binomial coefficients
• Computation of Clebsch-Gordan and Gaunt coefficients using binomial coefficients
• scientific article; zbMATH DE number 3824228 (Why is no real title available?)

Cited in

(5)

• Derivation of closed analytical expressions for Rosen-Morse Franck-Condon factors
• An algebraic approach to calculate Franck-Condon factors
• Calculation of Displacement Matrix Elements for Morse Oscillators
• Franck-Condon factors for diatomic molecules for an arbitrary anharmonic potential
• Recurrence relations for two-center harmonic oscillator integrals

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